# generated using pymatgen
data_Li3Mn3O8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.34029356
_cell_length_b   8.34029356
_cell_length_c   8.30310529
_cell_angle_alpha   89.04957999
_cell_angle_beta   89.04957999
_cell_angle_gamma   90.21243491
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li3Mn3O8
_chemical_formula_sum   'Li12 Mn12 O32'
_cell_volume   577.40463679
_cell_formula_units_Z   4
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
loop_
 _atom_site_type_symbol
 _atom_site_label
 _atom_site_symmetry_multiplicity
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_occupancy
  Li  Li0  1  0.74817500  0.25182500  0.50000000  1.0
  Li  Li1  1  0.22169800  0.19177700  0.50436600  1.0
  Li  Li2  1  0.39143200  0.38636800  0.64048800  1.0
  Li  Li3  1  0.00159100  0.81940600  0.72706900  1.0
  Li  Li4  1  0.62128100  0.12922900  0.86946000  1.0
  Li  Li5  1  0.13469200  0.61342300  0.89001800  1.0
  Li  Li6  1  0.50054400  0.49945600  0.00000000  1.0
  Li  Li7  1  0.38657700  0.86530800  0.10998200  1.0
  Li  Li8  1  0.87077100  0.37871900  0.13054000  1.0
  Li  Li9  1  0.18059400  0.99840900  0.27293100  1.0
  Li  Li10  1  0.61363200  0.60856800  0.35951200  1.0
  Li  Li11  1  0.80822300  0.77830200  0.49563400  1.0
  Mn  Mn12  1  0.25999500  0.74000500  0.50000000  1.0
  Mn  Mn13  1  0.00544400  0.50181200  0.50262300  1.0
  Mn  Mn14  1  0.50462500  0.75109900  0.74755800  1.0
  Mn  Mn15  1  0.75457000  0.50781700  0.75253000  1.0
  Mn  Mn16  1  0.99576400  0.26091300  0.75905700  1.0
  Mn  Mn17  1  0.75238400  0.75450100  0.99635200  1.0
  Mn  Mn18  1  0.99515200  0.00484800  0.00000000  1.0
  Mn  Mn19  1  0.24549900  0.24761600  0.00364800  1.0
  Mn  Mn20  1  0.73908700  0.00423600  0.24094300  1.0
  Mn  Mn21  1  0.49218300  0.24543000  0.24747000  1.0
  Mn  Mn22  1  0.24890100  0.49537500  0.25244200  1.0
  Mn  Mn23  1  0.49818800  0.99455600  0.49737700  1.0
  O  O24  1  0.03450900  0.72899200  0.51634800  1.0
  O  O25  1  0.49613900  0.75779200  0.50990600  1.0
  O  O26  1  0.77972100  0.52016400  0.51713400  1.0
  O  O27  1  0.00448700  0.27409900  0.53295600  1.0
  O  O28  1  0.51260000  0.97891300  0.71944700  1.0
  O  O29  1  0.27871300  0.73282600  0.73055400  1.0
  O  O30  1  0.99072900  0.49481500  0.74157500  1.0
  O  O31  1  0.53084800  0.52270600  0.75022200  1.0
  O  O32  1  0.76772300  0.28273600  0.75657000  1.0
  O  O33  1  0.74483500  0.74368000  0.75548500  1.0
  O  O34  1  0.99025500  0.03802800  0.77479300  1.0
  O  O35  1  0.22950600  0.26381500  0.77744300  1.0
  O  O36  1  0.52315400  0.75246900  0.97162900  1.0
  O  O37  1  0.75799500  0.52965300  0.98248700  1.0
  O  O38  1  0.98147100  0.78247700  0.97150400  1.0
  O  O39  1  0.00955500  0.24180900  0.99477400  1.0
  O  O40  1  0.75819100  0.99044500  0.00522600  1.0
  O  O41  1  0.21752300  0.01852900  0.02849600  1.0
  O  O42  1  0.47034700  0.24200500  0.01751300  1.0
  O  O43  1  0.24753100  0.47684600  0.02837100  1.0
  O  O44  1  0.73618500  0.77049400  0.22255700  1.0
  O  O45  1  0.96197200  0.00974500  0.22520700  1.0
  O  O46  1  0.25632000  0.25516500  0.24451500  1.0
  O  O47  1  0.71726400  0.23227700  0.24343000  1.0
  O  O48  1  0.47729400  0.46915200  0.24977800  1.0
  O  O49  1  0.50518500  0.00927100  0.25842500  1.0
  O  O50  1  0.26717400  0.72128700  0.26944600  1.0
  O  O51  1  0.02108700  0.48740000  0.28055300  1.0
  O  O52  1  0.72590100  0.99551300  0.46704400  1.0
  O  O53  1  0.47983600  0.22027900  0.48286600  1.0
  O  O54  1  0.24220800  0.50386100  0.49009400  1.0
  O  O55  1  0.27100800  0.96549100  0.48365200  1.0